[
  {
    "molid": "mol38464",
    "smiles": "Cc1cc2cc3ccc(N(C)C)cc3nc2cc1N",
    "microspecies": [
      {
        "id": "0_1",
        "charge": 0,
        "smiles": "Cc1cc2cc3ccc(N(C)C)cc3nc2cc1N",
        "std_free_energy": -5.03123140335083,
        "relative_population": 1.0
      },
      {
        "id": "1_1",
        "charge": 1,
        "smiles": "Cc1cc2cc3ccc(N(C)C)cc3[nH+]c2cc1N",
        "std_free_energy": -14.286996841430664,
        "relative_population": 0.8456363288274777
      },
      {
        "id": "1_3",
        "charge": 1,
        "smiles": "Cc1cc2cc3ccc(N(C)C)cc3nc2cc1[NH3+]",
        "std_free_energy": -12.329477310180664,
        "relative_population": 0.11941082572628031
      }
    ],
    "macro_pka_values": [
      {
        "pka_value": 9.85000038146973,
        "charge_state_pre": 1,
        "charge_state_post": 0,
        "data_source": "QSARToolbox"
      }
    ]
  }
]